SCHEMBL29483597

SCHEMBL29483597

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 2/20 0.74
CTSK P43235 5/20 0.68
CTSL P07711 5/20 0.67
CTSB P07858 4/20 0.67
MME P08473 1/20 0.66
ECE1 P42892 1/20 0.66
HTRA1 Q92743 1/20 0.66
CTSS P25774 3/20 0.64

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21219352 1.00 CAPN1 (0.74) CAPN1CTSKCTSLCTSBMME
SCHEMBL4320484 1.00 CAPN1 (0.74) CAPN1CTSKCTSLCTSBMME
SCHEMBL21219280 1.00 CAPN1 (0.74) CAPN1CTSKCTSLCTSBMME
SCHEMBL9831181 1.00 CAPN1 (0.74) CAPN1CTSKCTSLCTSBMME
SCHEMBL21219351 1.00 CAPN1 (0.74) CAPN1CTSKCTSLCTSBMME
SCHEMBL931659 0.95 CAPN1 (0.69) CAPN1CTSKCTSLCTSBMME
SCHEMBL27809377 0.95 CAPN1 (0.78) CAPN1CTSKCTSLCTSBHTRA1
SCHEMBL9828791 0.95 CAPN1 (0.78) CAPN1CTSKCTSLCTSBHTRA1
SCHEMBL7327426 0.95 CAPN1 (0.78) CAPN1CTSKCTSLCTSBHTRA1
SCHEMBL25406813 0.94 CTSK (0.77) CAPN1CTSKCTSLCTSBCTSS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113710684-B Process for producing peptide compound 日产化学株式会社 2024-06-11 CN disclosed
US-20220204550-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND NISSAN CHEMICAL CORPORATION (JP) 2022-06-30 US disclosed
EP-3960751-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND Nissan Chemical Corporation (JP) 2022-03-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220204550-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND VIP, NPPA, NGLY1 CAPN1 1023/4885CTSK 1313/4885CTSL 232/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.